C35H24N6O13S2

Base Information

• Chemical Name: C35H24N6O13S2
• CAS No.: 47893-59-4
• Molecular Formula: C₃₅H₂₄N₆O₁₃S₂
• Molecular Weight: 800.74
• DSSTox Substance ID: DTXSID50963959
• Mol file: 47893-59-4.mol

Synonyms:C35H24N6O13S2;C35-H24-N6-O13-S2;DTXSID50963959;Benzoic acid, 4,4'-[carbonylbis[imino(1-hydroxy-3-sulfo-6,2-naphthalenediyl)azo]]bis-;4,4'-{Carbonylbis[azanediyl(5-oxo-7-sulfonaphthalen-2-yl-6-ylidene)hydrazin-1-yl-2-ylidene]}dibenzoic acid

Chemical Property of C35H24N6O13S2

Chemical Property:

• PSA: 324.15000
• Density: 1.71g/cm3
• LogP: 6.96680
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 10
• Exact Mass: 800.08427719
• Heavy Atom Count: 56
• Complexity: 1820

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=O)O)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC=C(C=C6)C(=O)O)C(=C5)S(=O)(=O)O)S(=O)(=O)O

Technology Process of C35H24N6O13S2

There total 1 articles about C35H24N6O13S2 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

AMI-1 (134-47-4) + 4-amino-benzoic acid (150-13-0,159246-81-8,8014-65-1) → calcomine orange (47893-59-4)

Guidance literature:

4-amino-benzoic acid; With sulfuric acid; sodium nitrite;

AMI-1; With sodium carbonate; at 20 ℃; pH=9;

DOI:10.1006/bioo.2000.1166

upstream raw materials:

AMI-1

4-amino-benzoic acid